List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
375368 |
131500112 |
2 |
NOF2H2C4 |
ABC2D2E4 |
-226.13 |
4.99 |
-9.99 |
-1.34 |
0 |
|
|
375369 |
131500115 |
2 |
NOF2H2C4 |
ABC2D2E4 |
-239.62 |
3.55 |
-9.96 |
-1.32 |
0 |
|
|
375370 |
131500120 |
2 |
NOF2H2C4 |
ABC2D2E4 |
-225.21 |
4.63 |
-9.98 |
-1.42 |
0 |
|
|
375371 |
131500121 |
2 |
NOF2H2C4 |
ABC2D2E4 |
-226.62 |
5.33 |
-9.85 |
-1.41 |
0 |
|
|
375372 |
131500124 |
2 |
NOF2H2C4 |
ABC2D2E4 |
-233.8 |
2.97 |
-10.0 |
-1.55 |
0 |
|
|
375373 |
131500125 |
1 |
BrClNSO2F3H4C7 |
ABCDE2F3G4H7 |
-212.09 |
9.38 |
-9.58 |
-1.63 |
0 |
|
|
375374 |
131500132 |
1 |
ON4C9H12 |
AB4C9D12 |
61.95 |
6.03 |
-8.59 |
-0.9 |
0 |
|
|
375375 |
131500133 |
1 |
ON4C9H12 |
AB4C9D12 |
44.19 |
2.78 |
-9.48 |
-0.73 |
0 |
|
|
375376 |
131500136 |
1 |
ON4C9H12 |
AB4C9D12 |
47.23 |
4.37 |
-9.25 |
-0.85 |
0 |
|
|
375377 |
131500142 |
1 |
BrFNSH7C11 |
ABCDE7F11 |
18.18 |
2.69 |
-9.1 |
-1.3 |
0 |
|
|
375378 |
131500143 |
1 |
BrFNSH7C11 |
ABCDE7F11 |
16.93 |
3.02 |
-9.13 |
-1.36 |
0 |
|
|
375379 |
131500144 |
1 |
BrFNSH7C11 |
ABCDE7F11 |
17.16 |
3.28 |
-9.02 |
-1.3 |
0 |
|
|
375380 |
131500145 |
1 |
BrFNSH7C11 |
ABCDE7F11 |
17.13 |
3.68 |
-8.99 |
-1.23 |
0 |
|
|
375381 |
131500146 |
1 |
BrFNSH7C11 |
ABCDE7F11 |
17.05 |
3.55 |
-9.08 |
-1.33 |
0 |
|
|
375382 |
131500148 |
1 |
O2N5C9H15 |
A2B5C9D15 |
-30.35 |
3.85 |
-9.64 |
0.15 |
0 |
|
|
375383 |
131500151 |
1 |
BrSO3H9C11 |
ABC3D9E11 |
-91.95 |
3.42 |
-8.8 |
-1.39 |
0 |
|
|
375384 |
131500155 |
1 |
NO2C12H19 |
AB2C12D19 |
-98.2 |
3.09 |
-9.08 |
0.18 |
0 |
|
|
375385 |
131500161 |
1 |
ON3C10H11 |
AB3C10D11 |
19.55 |
3.9 |
-9.01 |
-0.42 |
0 |
|
|
375386 |
131500165 |
1 |
N2O3C10H14 |
A2B3C10D14 |
-53.61 |
5.4 |
-9.32 |
-1.5 |
0 |
|
|
375387 |
131500172 |
1 |
INOC12H16 |
ABCD12E16 |
-9.45 |
0.9 |
-8.83 |
-0.64 |
0 |
|
|
375388 |
131500173 |
1 |
ON3C10H11 |
AB3C10D11 |
12.11 |
8.46 |
-8.88 |
-1.25 |
0 |
|
|
375389 |
131500174 |
1 |
BrOF2N2C9H11 |
ABC2D2E9F11 |
-133.38 |
1.31 |
-8.66 |
-0.11 |
0 |
|
|
375390 |
131500175 |
1 |
ON3C10H11 |
AB3C10D11 |
37.3 |
5.68 |
-8.72 |
-0.94 |
0 |
|
|
375391 |
131500180 |
1 |
NOSC12H19 |
ABCD12E19 |
-46.43 |
1.61 |
-8.4 |
0.0 |
0 |
|
|
375392 |
131500181 |
1 |
NOC13H19 |
ABC13D19 |
-42.97 |
1.88 |
-8.99 |
0.3 |
0 |
|
|
375393 |
131500182 |
1 |
BrNOF3H7C9 |
ABCD3E7F9 |
-171.04 |
1.08 |
-9.62 |
-1.16 |
0 |
|
|
375394 |
131500183 |
1 |
NOF3C10H12 |
ABC3D10E12 |
-193.14 |
5.39 |
-9.79 |
-0.38 |
0 |
|
|
375395 |
131500185 |
1 |
N2O3C10H14 |
A2B3C10D14 |
-47.84 |
8.54 |
-10.1 |
-1.35 |
0 |
|
|
375396 |
131500186 |
1 |
NOF3C10H12 |
ABC3D10E12 |
-189.33 |
5.45 |
-9.36 |
-0.42 |
0 |
|
|
375397 |
131500193 |
1 |
NO2C11H13 |
AB2C11D13 |
-47.19 |
4.63 |
-8.87 |
-0.08 |
0 |
|
|
375398 |
131500196 |
1 |
ON2C8H8 |
AB2C8D8 |
7.45 |
3.38 |
-10.32 |
-1.05 |
0 |
|
|
375399 |
131500200 |
1 |
ON2C8H8 |
AB2C8D8 |
11.35 |
2.0 |
-9.96 |
-0.8 |
0 |
|
|
375400 |
131500202 |
1 |
ON2C8H8 |
AB2C8D8 |
38.1 |
5.24 |
-8.93 |
-0.36 |
0 |
|
|
375401 |
131500207 |
1 |
NOF4H7C9 |
ABC4D7E9 |
-215.23 |
4.6 |
-9.53 |
-1.11 |
0 |
|
|
375402 |
131500209 |
1 |
N2F3C10H13 |
A2B3C10D13 |
-144.67 |
5.07 |
-9.86 |
-0.82 |
0 |
|
|
375403 |
131500210 |
1 |
OBr2N2C10H10 |
AB2C2D10E10 |
18.99 |
3.61 |
-9.37 |
-0.8 |
0 |
|
|
375404 |
131500215 |
1 |
FNOH10C11 |
ABCD10E11 |
-37.09 |
6.11 |
-10.29 |
-1.41 |
0 |
|
|
375405 |
131500216 |
1 |
FNOH10C11 |
ABCD10E11 |
-23.59 |
2.84 |
-9.97 |
-0.57 |
0 |
|
|
375406 |
131500219 |
1 |
FNO4H6C8 |
ABC4D6E8 |
-117.6 |
1.06 |
-10.51 |
-1.82 |
0 |
|
|
375407 |
131500221 |
1 |
NO4C9H11 |
AB4C9D11 |
-80.86 |
5.85 |
-9.49 |
-1.41 |
0 |
|
|
375408 |
131500223 |
1 |
NO3C6H7 |
AB3C6D7 |
-105.79 |
3.14 |
-9.58 |
-0.89 |
0 |
|
|
375409 |
131523252 |
2 |
NOC6H9 |
ABC6D9 |
-64.31 |
1.38 |
-8.06 |
0.09 |
0 |
|
|
375410 |
131523260 |
1 |
OCl3H9C10 |
AB3C9D10 |
-51.89 |
2.42 |
-9.7 |
-0.54 |
0 |
|
|
375411 |
131529531 |
1 |
O2N3C10H13 |
A2B3C10D13 |
-62.13 |
5.36 |
-8.97 |
-0.11 |
0 |
|
|
375412 |
131529543 |
1 |
ClN3H6C9 |
AB3C6D9 |
74.66 |
2.04 |
-9.03 |
-1.44 |
0 |
|
|
375413 |
131529564 |
1 |
O2N3H9C10 |
A2B3C9D10 |
72.4 |
5.83 |
-10.12 |
-1.98 |
0 |
|
|
375414 |
131529578 |
1 |
NOF2C11H13 |
ABC2D11E13 |
-119.15 |
1.25 |
-9.04 |
-0.33 |
0 |
|
|
375415 |
131529587 |
1 |
N2O2C11H12 |
A2B2C11D12 |
-29.74 |
5.48 |
-9.22 |
-0.43 |
0 |
|
|
375416 |
131529590 |
2 |
ON2C5H5 |
AB2C5D5 |
-7.95 |
8.92 |
-9.84 |
-1.12 |
0 |
|
|
375417 |
131529593 |
1 |
BrFNH9C11 |
ABCD9E11 |
-4.88 |
1.65 |
-9.64 |
-0.58 |
0 |
|
|
375418 |
131529598 |
2 |
ON2C5H5 |
AB2C5D5 |
-3.47 |
6.34 |
-9.82 |
-1.57 |
0 |
|
|
375419 |
131529602 |
1 |
S2N3C11H15 |
A2B3C11D15 |
32.76 |
1.54 |
-8.33 |
-0.28 |
0 |
|
|
375420 |
131529606 |
1 |
BrON3H8C9 |
ABC3D8E9 |
1.3 |
2.97 |
-8.57 |
-0.48 |
0 |
|
|
375421 |
131529610 |
1 |
ION2F3H4C8 |
ABC2D3E4F8 |
-124.12 |
3.14 |
-10.14 |
-1.78 |
0 |
|
|
375422 |
131529614 |
1 |
ION2F3H4C8 |
ABC2D3E4F8 |
-122.59 |
1.43 |
-10.48 |
-2.01 |
0 |
|
|
375423 |
131529618 |
1 |
ION2F3H4C8 |
ABC2D3E4F8 |
-128.65 |
2.63 |
-10.01 |
-1.72 |
0 |
|
|
375424 |
131529622 |
1 |
ION2F3H4C8 |
ABC2D3E4F8 |
-117.77 |
4.13 |
-10.21 |
-1.88 |
0 |
|
|
375425 |
131529625 |
1 |
ION2F3H4C8 |
ABC2D3E4F8 |
-118.35 |
3.76 |
-10.3 |
-1.91 |
0 |
|
|
375426 |
131529630 |
1 |
BrFNOH9C10 |
ABCDE9F10 |
-39.12 |
1.9 |
-9.78 |
-0.78 |
0 |
|
|
375427 |
131529634 |
1 |
BrFNOH9C10 |
ABCDE9F10 |
-39.59 |
1.98 |
-9.43 |
-1.12 |
0 |
|
|
375428 |
131529638 |
1 |
ClNSO3C9H12 |
ABCD3E9F12 |
-115.94 |
5.61 |
-10.01 |
-1.29 |
0 |
|
|
375429 |
131529663 |
2 |
NOC6H7 |
ABC6D7 |
-21.98 |
3.1 |
-8.36 |
0.05 |
0 |
|
|
375430 |
131529670 |
1 |
BrOS2C7H7 |
ABC2D7E7 |
-12.03 |
2.75 |
-8.86 |
-0.54 |
0 |
|
|
375431 |
131529673 |
1 |
BrOS2C7H7 |
ABC2D7E7 |
4.82 |
4.46 |
-8.6 |
-0.46 |
0 |
|
|
375432 |
131529674 |
1 |
BrOS2C7H7 |
ABC2D7E7 |
-2.58 |
4.34 |
-8.59 |
-0.7 |
0 |
|
|
375433 |
131529676 |
1 |
BrN2C11H11 |
AB2C11D11 |
46.11 |
6.46 |
-9.55 |
-0.4 |
0 |
|
|
375434 |
131529681 |
1 |
N2F3O3H7C8 |
A2B3C3D7E8 |
-173.16 |
5.39 |
-10.29 |
-1.73 |
0 |
|
|
375435 |
131529686 |
1 |
ClNF5H7C9 |
ABC5D7E9 |
-251.74 |
2.32 |
-10.2 |
-1.15 |
0 |
|
|
375436 |
131529689 |
1 |
BrOF2N2H7C9 |
ABC2D2E7F9 |
-90.87 |
4.35 |
-9.9 |
-1.13 |
0 |
|
|
375437 |
131529692 |
1 |
NO2C13H19 |
AB2C13D19 |
-85.48 |
2.51 |
-8.91 |
0.18 |
0 |
|
|
375438 |
131529693 |
1 |
FNOC13H18 |
ABCD13E18 |
-89.56 |
2.05 |
-9.01 |
-0.02 |
0 |
|
|
375439 |
131529707 |
1 |
BrN2F3H6C9 |
AB2C3D6E9 |
-101.58 |
2.29 |
-10.36 |
-1.23 |
0 |
|
|
375440 |
131529708 |
1 |
NOC13H19 |
ABC13D19 |
-37.27 |
2.63 |
-8.84 |
0.22 |
0 |
|
|
375441 |
131529709 |
1 |
ClNOC12H12 |
ABCD12E12 |
-16.97 |
1.42 |
-9.15 |
-0.99 |
0 |
|
|
375442 |
131529710 |
1 |
N2O2C11H14 |
A2B2C11D14 |
-52.29 |
3.07 |
-9.47 |
-1.01 |
0 |